SCHEMBL6772453

SCHEMBL6772453

CCOC(=O)CC(Cc1cccc(OC)c1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.54
MTNR1B P49286 2/20 0.54
F10 P00742 2/20 0.50
F2 P00734 2/20 0.47
FFAR1 O14842 1/20 0.47
CYP1A2 P05177 1/20 0.46
TAAR1 Q96RJ0 2/20 0.46
BCHE P06276 2/20 0.45
KDM4E B2RXH2 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
TACR1 P25103 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6179834 0.86 F2 (0.53) MTNR1AMTNR1BF2FFAR1KDM4E
SCHEMBL31555289 0.86 F2 (0.56) MTNR1AMTNR1BF10F2
SCHEMBL6772943 0.85 F10 (0.52) MTNR1AMTNR1BF10F2SLC6A2
SCHEMBL31619581 0.82 TAAR1 (0.54) FFAR1CYP1A2TAAR1KDM4EL3MBTL1
SCHEMBL19432998 0.82 TAAR1 (0.54) FFAR1CYP1A2TAAR1KDM4EL3MBTL1
SCHEMBL13744616 0.81 TAAR1 (0.56) FFAR1CYP1A2TAAR1KDM4EL3MBTL1
SCHEMBL31483355 0.81 TAAR1 (0.49) FFAR1CYP1A2TAAR1KDM4EL3MBTL1
SCHEMBL3168923 0.80 TAAR1 (0.51) FFAR1CYP1A2TAAR1KDM4EL3MBTL1
SCHEMBL3162848 0.79 CYP1A2 (0.47) FFAR1CYP1A2TAAR1KDM4EL3MBTL1
SCHEMBL1369571 0.79 L3MBTL1 (0.52) MTNR1AMTNR1BF10F2L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833366-B1 Dihydrostilbene alkanoic acid derivatives PHARMACIA CORPORATION 2004-12-21 US disclosed
US-6720315-B2 FOR INHIBITING BONE RESORPTION, PERIODONTAL DISEASE, OSTEOPOROSIS, HUMORAL HYPERCALCEMIA OF MALIGNANCY, PAGET'S DISEASE, TUMOR METASTASIS, SOLID TUMOR GROWTH, ANGIOGENESIS, MACULAR DEGENERATION AND DIABETIC RETINOPATHY RETINOPATHY PHARMACIA CORPORATION 2004-04-13 US disclosed
EP-1289959-A1 DIHYDROSTILBENE ALKANOIC ACID DERIVATIVES USEFUL AS VITRONECTIN ANTAGONISTS Pharmacia Corporation (US) 2003-03-12 EP disclosed
US-20020099209-A1 Dihydrostilbene alkanoic acid derivatives PHARMACIA CORPORATION 2002-07-25 US disclosed
WO-2001096310-A1 DIHYDROSTILBENE ALKANOIC ACID DERIVATIVES USEFUL AS VITRONECTIN ANTAGONISTS PHARMACIA CORPORATION (US) 2001-12-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020099209-A1 Dihydrostilbene alkanoic acid derivatives ITGA5, ITGB5, ITGB1 MTNR1A 2887/4885MTNR1B 2529/4885F10 1163/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.